(5-Bromo-3,6-diphenyl-1,4-dithiin-2-yl)(hydroxy)azane oxide
TL;DR: (5-Bromo-3,6-diphenyl-1,4-dithiin-2-yl)(hydroxy)azane oxide (CAS 70103-58-1) is a chemical compound with molecular formula C16H10BrNO2S2 and molecular weight 390.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-5-nitro-3,6-diphenyl-1,4-dithiine
Also Known As: 2-bromo-5-nitro-3,6-diphenyl-1,4-dithiine, (5-Bromo-3,6-diphenyl-1,4-dithiin-2-yl)(hydroxy)azane oxide, 1,4-Dithiin,2-bromo-5-nitro-3,6-diphenyl-, 2-BROMO-5-NITRO-3,6-DIPHENYL-1,4-DITHIIN, 1,4-DITHIIN, 2-BROMO-5-NITRO-3,6-DIPHENYL-
| Molecular Formula | C16H10BrNO2S2 |
|---|---|
| Molecular Weight | 390.93 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 96.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 390.93362 |
| Heavy Atoms | 22 |
| Complexity | 501.0 |
Chemical Identifiers
| CAS Number | 70103-58-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(SC(=C(S2)Br)C3=CC=CC=C3)[N+](=O)[O-] |
| InChIKey | SWKBBSCOHMIXAT-UHFFFAOYSA-N |
Product Overview
(5-Bromo-3,6-diphenyl-1,4-dithiin-2-yl)(hydroxy)azane oxide (CAS 70103-58-1), with molecular formula C16H10BrNO2S2 and molecular weight 390.93 g/mol. IUPAC: 2-bromo-5-nitro-3,6-diphenyl-1,4-dithiine.
Chemical Property Profile of (5-Bromo-3,6-diphenyl-1,4-dithiin-2-yl)(hydroxy)azane oxide
Property Insights of (5-Bromo-3,6-diphenyl-1,4-dithiin-2-yl)(hydroxy)azane oxide
The XLogP value of 5.5 indicates that (5-Bromo-3,6-diphenyl-1,4-dithiin-2-yl)(hydroxy)azane oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-Bromo-3,6-diphenyl-1,4-dithiin-2-yl)(hydroxy)azane oxide. Following Lipinski's Rule of Five, (5-Bromo-3,6-diphenyl-1,4-dithiin-2-yl)(hydroxy)azane oxide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (5-Bromo-3,6-diphenyl-1,4-dithiin-2-yl)(hydroxy)azane oxide?
The CAS number of (5-Bromo-3,6-diphenyl-1,4-dithiin-2-yl)(hydroxy)azane oxide is 70103-58-1.
What is the molecular formula of (5-Bromo-3,6-diphenyl-1,4-dithiin-2-yl)(hydroxy)azane oxide?
The molecular formula of (5-Bromo-3,6-diphenyl-1,4-dithiin-2-yl)(hydroxy)azane oxide is C16H10BrNO2S2.
What is the molecular weight of (5-Bromo-3,6-diphenyl-1,4-dithiin-2-yl)(hydroxy)azane oxide?
The molecular weight of (5-Bromo-3,6-diphenyl-1,4-dithiin-2-yl)(hydroxy)azane oxide is 390.93 g/mol.
Where can I buy (5-Bromo-3,6-diphenyl-1,4-dithiin-2-yl)(hydroxy)azane oxide?
You can request a quote for (5-Bromo-3,6-diphenyl-1,4-dithiin-2-yl)(hydroxy)azane oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-Bromo-3,6-diphenyl-1,4-dithiin-2-yl)(hydroxy)azane oxide?
Yes, KEHONG BIO provides custom synthesis services for (5-Bromo-3,6-diphenyl-1,4-dithiin-2-yl)(hydroxy)azane oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.